4-[[[(E)-octadec-9-enoyl]amino]methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[[(E)-octadec-9-enoyl]amino]methyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[[[(E)-octadec-9-enoyl]amino]methyl]cyclohexanecarboxylic acid CAS Name: 4-[[[(E)-1-oxooctadec-9-enyl]amino]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[[(E)-octadec-9-enoyl]amino]methyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[[[(E)-octadec-9-enoyl]amino]methyl]cyclohexanecarboxylic acid Formula: C26H47NO3 MolecularWeight: 421.65628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NCC1CCC(CC1)C(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)NCC1CCC(CC1)C(=O)O

InChI

InChI=1S/C26H47NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(28)27-22-23-18-20-24(21-19-23)26(29)30/h9-10,23-24H,2-8,11-22H2,1H3,(H,27,28)(H,29,30)/b10-9+